Geometry & MOs

Info

ID:	171270
PubChem CID:	75350949
Reduced:	BrNSO4H18C23 (1)
Stoich.:	ABCD4E18F23 (1)
Weight, g/mol:	479.00382
ΔH_f, kcal/mol:	-61.11
Dipole, Da:	4.47
IP(EA), eV:	-8.68(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-[2-(2-methoxyphenoxy)ethyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OCCN2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)Br)SC2=O

DOS

IR

Vibrations